| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 13 | Yes |
Popular Name: Simazine Simazine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 122-34-9 , 139429-39-3 , [122-34-9]
2-Chloro-4,6-bis(ethylamino)-1,3,5-triazine
2-Chloro-4,6-bis(ethylamino)-1,3,5-triazine, 96%
6-chloro-N,N'-diethyl-1,3,5-triazine-2,4-diamine
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.25 | 6.38 | -5.12 | 2 | 5 | 0 | 63 | 201.661 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 227-229? | Alfa-Aesar |
| Melting_Point | 227-229° | Alfa-Aesar |
| Patent Database Links | EP0862860; WO2005030736 | ChEBI |
| Therapy | herbicide | SMDC MicroSource |
| Indications | pesticide, herbicide | KeyOrganics Bioactives |
